==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 11-MAY-06 2GZO . COMPND 2 MOLECULE: UPF0301 PROTEIN SO3346; . SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA ONEIDENSIS; . AUTHOR K.K.SINGARAPU,G.LIU,A.ELETSKY,D.XU,D.K.SUKUMARAN,J.MEI, . 187 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12382.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 58.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 15.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 27 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 156 0, 0.0 2,-2.4 0, 0.0 142,-0.0 0.000 360.0 360.0 360.0 16.1 -7.0 21.3 -4.3 2 2 A E + 0 0 125 141,-0.0 2,-0.3 142,-0.0 138,-0.1 -0.355 360.0 92.1 -83.4 60.5 -4.8 22.3 -1.3 3 3 A S - 0 0 66 -2,-2.4 30,-0.1 136,-0.1 2,-0.0 -0.852 61.1-152.2-154.6 114.4 -5.7 19.3 0.8 4 4 A L + 0 0 11 -2,-0.3 28,-0.1 28,-0.3 32,-0.1 -0.243 51.1 66.6 -83.3 176.7 -3.7 16.1 0.9 5 5 A Q S S+ 0 0 59 2,-0.2 23,-0.2 30,-0.1 25,-0.1 0.291 82.5 46.1 84.9 142.6 -4.9 12.5 1.7 6 6 A N S S+ 0 0 45 21,-2.0 146,-1.5 1,-0.2 2,-0.3 0.819 104.0 66.9 65.5 36.4 -7.3 10.3 -0.3 7 7 A H E S-AB 27 151A 14 20,-0.9 20,-1.9 144,-0.2 -2,-0.2 -0.980 80.3 -93.6-170.5 171.3 -5.6 11.0 -3.7 8 8 A F E -AB 26 150A 3 142,-2.1 142,-1.4 -2,-0.3 2,-0.5 -0.564 21.4-135.8 -96.0 155.5 -2.5 10.5 -5.8 9 9 A L E -AB 25 149A 0 16,-2.2 16,-1.2 -2,-0.2 2,-0.6 -0.966 17.1-161.4-106.7 120.1 0.6 12.7 -6.2 10 10 A I E -AB 24 148A 13 138,-3.0 138,-3.1 -2,-0.5 2,-0.5 -0.909 10.5-176.8-103.4 116.9 1.7 13.0 -9.8 11 11 A A E -A 23 0A 3 -2,-0.6 12,-1.0 12,-0.6 136,-0.1 -0.955 21.7-131.6-120.4 118.3 5.2 14.2 -10.2 12 12 A M > - 0 0 108 -2,-0.5 2,-2.4 134,-0.2 3,-0.9 -0.266 35.5 -99.8 -62.6 150.2 6.8 14.8 -13.6 13 13 A P T 3 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.112 89.7 114.4 -71.1 44.7 10.3 13.2 -14.1 14 14 A S T 3 + 0 0 98 -2,-2.4 2,-1.0 1,-0.2 -2,-0.0 0.751 69.0 65.1 -79.6 -26.3 12.1 16.5 -13.4 15 15 A L S < S+ 0 0 63 -3,-0.9 3,-0.2 3,-0.0 -1,-0.2 -0.771 76.3 153.0 -99.1 87.9 13.6 14.8 -10.4 16 16 A D + 0 0 97 -2,-1.0 3,-0.1 1,-0.2 6,-0.0 -0.485 41.3 53.6-108.4-179.3 15.7 12.1 -11.9 17 17 A D S S+ 0 0 158 -2,-0.2 2,-0.3 1,-0.1 -1,-0.2 0.765 99.6 82.0 60.9 28.2 18.9 10.3 -10.8 18 18 A T - 0 0 49 -3,-0.2 2,-0.7 3,-0.1 -1,-0.1 -0.950 66.1-149.6-158.9 138.8 17.1 9.4 -7.6 19 19 A F S S+ 0 0 164 -2,-0.3 3,-0.1 1,-0.1 -3,-0.1 -0.748 87.5 52.2-113.9 81.5 14.6 6.7 -6.6 20 20 A F S S+ 0 0 101 -2,-0.7 -1,-0.1 1,-0.4 2,-0.1 0.088 95.2 70.3-175.3 -34.5 12.4 8.2 -3.9 21 21 A E S S+ 0 0 79 -6,-0.1 -1,-0.4 -5,-0.0 -10,-0.1 -0.230 90.6 15.5 -83.2-178.3 11.3 11.5 -5.4 22 22 A R S S+ 0 0 36 -3,-0.1 -10,-0.1 1,-0.1 19,-0.1 0.022 81.4 89.0 52.3-159.5 8.8 11.9 -8.3 23 23 A T E S-A 11 0A 8 -12,-1.0 -12,-0.6 1,-0.1 2,-0.6 0.105 89.1 -44.9 63.8-174.9 6.5 9.0 -9.4 24 24 A V E +A 10 0A 13 -14,-0.2 16,-1.7 16,-0.1 2,-0.4 -0.817 56.1 179.2 -96.6 120.3 3.0 8.3 -8.1 25 25 A I E -AC 9 39A 6 -16,-1.2 -16,-2.2 -2,-0.6 2,-0.6 -0.968 17.3-146.2-119.9 135.8 2.5 8.3 -4.4 26 26 A Y E -AC 8 38A 50 12,-2.7 12,-3.0 -2,-0.4 2,-0.5 -0.901 9.0-153.1-105.6 121.5 -0.8 7.6 -2.7 27 27 A L E +AC 7 37A 0 -20,-1.9 -21,-2.0 -2,-0.6 -20,-0.9 -0.812 22.8 164.9 -95.8 125.8 -1.6 9.5 0.5 28 28 A C + 0 0 18 8,-1.9 9,-0.2 -2,-0.5 -1,-0.2 0.760 55.7 63.2-109.1 -35.9 -3.9 7.8 2.9 29 29 A E - 0 0 100 7,-2.2 2,-0.4 -24,-0.1 -23,-0.1 -0.452 66.6-143.6 -91.7 165.5 -3.5 9.6 6.2 30 30 A H + 0 0 82 5,-0.2 5,-0.3 -2,-0.1 3,-0.1 -0.886 19.2 174.1-133.4 100.9 -4.3 13.3 7.0 31 31 A D B > -D 34 0B 62 3,-1.4 2,-1.5 -2,-0.4 3,-1.4 -0.191 46.3-120.2-102.6 40.0 -1.9 15.0 9.4 32 32 A E T 3 S+ 0 0 157 1,-0.3 -28,-0.3 -28,-0.1 -1,-0.2 -0.413 107.2 27.9 64.0 -86.4 -3.5 18.4 9.0 33 33 A K T 3 S+ 0 0 97 -2,-1.5 107,-1.4 -3,-0.1 -1,-0.3 0.708 138.6 19.2 -77.3 -21.5 -0.5 20.3 7.7 34 34 A G B < -D 31 0B 3 -3,-1.4 -3,-1.4 105,-0.2 2,-0.3 -0.596 69.9-141.0-131.4-166.4 0.9 17.1 6.2 35 35 A A - 0 0 0 -5,-0.3 2,-0.3 -2,-0.2 -5,-0.2 -0.902 14.3-127.8-166.1 134.4 -0.3 13.7 5.1 36 36 A M + 0 0 15 -2,-0.3 -7,-2.2 97,-0.1 -8,-1.9 -0.650 38.5 161.1 -87.4 139.7 1.1 10.1 5.3 37 37 A G E -C 27 0A 0 -10,-0.3 94,-3.1 -2,-0.3 2,-0.4 -0.934 34.4-116.6-151.9 173.5 1.3 8.1 2.1 38 38 A L E -C 26 0A 11 -12,-3.0 -12,-2.7 -2,-0.3 2,-0.6 -0.954 24.9-127.5-122.9 134.0 2.8 5.1 0.3 39 39 A V E -C 25 0A 25 36,-1.4 -14,-0.2 -2,-0.4 3,-0.2 -0.700 19.7-175.9 -83.9 119.2 5.0 5.2 -2.8 40 40 A I + 0 0 55 -16,-1.7 -16,-0.1 -2,-0.6 -1,-0.1 -0.323 34.4 136.4-107.8 48.9 3.7 2.9 -5.5 41 41 A N S S- 0 0 45 1,-0.2 -1,-0.2 -18,-0.1 -17,-0.1 0.978 71.5 -21.0 -59.9 -64.4 6.6 3.5 -7.9 42 42 A K S S- 0 0 133 -3,-0.2 2,-0.5 0, 0.0 -1,-0.2 -0.996 71.7 -92.7-153.4 143.8 7.4 0.0 -9.1 43 43 A P + 0 0 94 0, 0.0 2,-0.3 0, 0.0 30,-0.1 -0.464 54.6 168.8 -60.8 108.9 6.8 -3.6 -8.0 44 44 A L - 0 0 73 -2,-0.5 2,-0.6 30,-0.1 30,-0.0 -0.773 31.1-119.0-118.8 168.2 9.9 -4.6 -6.0 45 45 A G - 0 0 41 -2,-0.3 2,-0.7 26,-0.2 26,-0.2 -0.898 17.6-172.5-120.8 106.8 10.7 -7.6 -3.8 46 46 A I B -E 72 0C 42 26,-2.6 26,-0.9 -2,-0.6 5,-0.1 -0.873 38.6-118.3 -89.6 115.2 11.5 -7.3 -0.1 47 47 A E >> - 0 0 89 -2,-0.7 3,-1.1 24,-0.1 4,-0.7 -0.094 10.4-119.9 -59.3 153.5 12.5 -10.9 0.8 48 48 A V H 3> S+ 0 0 26 1,-0.3 4,-2.6 2,-0.2 3,-0.3 0.751 106.7 75.6 -64.6 -24.6 10.5 -12.8 3.4 49 49 A N H 3> S+ 0 0 93 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.890 92.9 51.6 -54.4 -41.4 13.7 -13.1 5.5 50 50 A S H <> S+ 0 0 51 -3,-1.1 4,-1.5 1,-0.2 -1,-0.2 0.853 109.7 48.9 -68.4 -34.3 13.3 -9.4 6.5 51 51 A L H X S+ 0 0 18 -4,-0.7 4,-3.2 -3,-0.3 5,-0.3 0.887 108.6 54.0 -69.6 -39.3 9.7 -10.1 7.6 52 52 A L H X S+ 0 0 73 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.893 106.3 52.4 -60.5 -41.6 10.9 -13.2 9.6 53 53 A E H < S+ 0 0 141 -4,-2.1 4,-0.5 -5,-0.2 -1,-0.2 0.889 114.7 42.7 -59.3 -40.9 13.4 -10.9 11.4 54 54 A Q H >< S+ 0 0 45 -4,-1.5 3,-1.3 1,-0.2 -2,-0.2 0.961 116.4 43.8 -72.2 -53.6 10.6 -8.6 12.3 55 55 A M H 3< S+ 0 0 7 -4,-3.2 7,-0.2 1,-0.3 -1,-0.2 0.687 98.7 76.4 -67.9 -20.0 7.9 -11.1 13.3 56 56 A D T 3< S+ 0 0 125 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.833 82.2 74.9 -58.6 -34.1 10.6 -13.1 15.2 57 57 A L S < S- 0 0 100 -3,-1.3 2,-1.7 -4,-0.5 5,-0.5 -0.734 74.5-154.4 -88.8 109.3 10.4 -10.5 18.0 58 58 A P + 0 0 95 0, 0.0 -3,-0.1 0, 0.0 -1,-0.1 -0.557 61.9 99.4 -86.0 74.6 7.2 -11.0 20.0 59 59 A T S S- 0 0 104 -2,-1.7 2,-0.2 -4,-0.0 -4,-0.0 0.631 100.0 -7.8-115.4 -67.3 6.6 -7.5 21.4 60 60 A E S S+ 0 0 164 -3,-0.4 -3,-0.1 2,-0.0 2,-0.0 -0.616 133.4 35.7-135.2 73.0 4.0 -5.7 19.3 61 61 A Q + 0 0 15 -2,-0.2 -6,-0.1 -6,-0.1 -5,-0.0 -0.257 67.5 169.5-174.0 -83.5 3.3 -8.0 16.3 62 62 A V + 0 0 72 -5,-0.5 -6,-0.1 -7,-0.2 -5,-0.1 0.275 35.4 85.5 68.6 160.0 3.4 -11.8 16.8 63 63 A S + 0 0 49 1,-0.1 3,-0.2 -8,-0.1 50,-0.1 0.982 33.5 179.1 76.9 84.7 2.3 -14.5 14.4 64 64 A A + 0 0 50 1,-0.2 -1,-0.1 -9,-0.1 -8,-0.0 -0.268 39.0 131.3-101.6 44.1 5.0 -15.6 11.9 65 65 A D + 0 0 107 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.320 31.6 123.6 -83.8 7.5 2.6 -18.1 10.5 66 66 A L - 0 0 20 -3,-0.2 47,-0.2 1,-0.1 3,-0.1 -0.321 52.1-150.7 -70.7 153.0 3.2 -17.0 6.9 67 67 A A - 0 0 69 45,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.944 64.5 -23.2 -87.8 -64.7 4.4 -19.6 4.3 68 68 A M + 0 0 154 44,-0.2 -1,-0.3 1,-0.1 47,-0.0 -0.845 51.1 160.5-141.2 176.4 6.5 -17.6 1.8 69 69 A G + 0 0 34 -2,-0.3 2,-3.0 -3,-0.1 -22,-0.1 0.076 10.6 154.5-157.5 -78.9 6.9 -14.1 0.5 70 70 A S S S+ 0 0 56 1,-0.1 2,-1.0 -25,-0.1 -21,-0.0 -0.319 76.6 56.6 66.4 -61.6 10.1 -13.1 -1.3 71 71 A Q + 0 0 136 -2,-3.0 2,-0.4 -26,-0.2 -26,-0.2 -0.712 68.9 154.8-105.3 80.8 8.4 -10.3 -3.3 72 72 A V B -E 46 0C 11 -2,-1.0 -26,-2.6 -26,-0.9 2,-0.2 -0.884 40.0-123.2-102.4 140.9 6.9 -8.0 -0.7 73 73 A L E -f 127 0D 44 53,-2.3 55,-3.0 -2,-0.4 2,-0.4 -0.556 17.7-152.6 -84.8 145.6 6.3 -4.4 -1.6 74 74 A M E -f 128 0D 68 53,-0.3 55,-0.2 -2,-0.2 56,-0.1 -0.972 13.2-171.6-117.7 132.8 7.7 -1.5 0.4 75 75 A G S S- 0 0 1 53,-2.9 -36,-1.4 -2,-0.4 54,-0.2 0.363 72.8 -36.0 -97.9 4.5 6.1 1.9 0.5 76 76 A G - 0 0 6 52,-0.7 -1,-0.4 -38,-0.1 55,-0.2 -0.881 62.9 -88.9 155.2 170.9 9.0 3.4 2.3 77 77 A P S > S+ 0 0 61 0, 0.0 3,-0.7 0, 0.0 2,-0.3 0.718 96.4 79.9 -83.5 -22.5 11.7 2.8 5.0 78 78 A V B 3 S+G 130 0E 51 52,-1.0 52,-2.0 1,-0.2 -3,-0.1 -0.641 100.0 10.7 -93.1 145.1 9.7 3.9 8.0 79 79 A S T > S+ 0 0 26 -2,-0.3 3,-2.0 50,-0.2 50,-1.1 0.816 74.2 153.6 59.0 34.5 7.1 1.6 9.8 80 80 A Q T < + 0 0 118 -3,-0.7 -1,-0.1 1,-0.3 -2,-0.1 0.645 64.3 70.1 -64.5 -15.6 8.4 -1.3 7.7 81 81 A D T 3 S+ 0 0 45 47,-0.1 -1,-0.3 -27,-0.1 -2,-0.1 0.635 121.5 0.8 -76.2 -15.7 7.1 -3.4 10.5 82 82 A R S < S+ 0 0 143 -3,-2.0 2,-0.2 25,-0.0 -2,-0.1 0.295 70.3 148.9-134.3 -95.5 3.6 -2.6 9.5 83 83 A G - 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